5-[[di(propan-2-yl)amino]methyl]-7-nitro-1,4-dihydroquinoxaline-2,3-dione hydrobromide

Systemtic Name: 5-[[di(propan-2-yl)amino]methyl]-7-nitro-1,4-dihydroquinoxaline-2,3-dione hydrobromide Openeye Name: 5-[(diisopropylamino)methyl]-7-nitro-1,4-dihydroquinoxaline-2,3-dione hydrobromide CAS Name: 5-[[di(propan-2-yl)amino]methyl]-7-nitro-1,4-dihydroquinoxaline-2,3-dione hydrobromide IUPAC Name: 5-[[di(propan-2-yl)amino]methyl]-7-nitro-1,4-dihydroquinoxaline-2,3-dione hydrobromide Traditional Name: 5-[(diisopropylamino)methyl]-7-nitro-1,4-dihydroquinoxaline-2,3-quinone hydrobromide Formula: C15H21BrN4O4 MolecularWeight: 401.25564

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N(CC1=CC(=CC2=C1NC(=O)C(=O)N2)[N+](=O)[O-])C(C)C.Br

Isomeric SMILES

CC(C)N(CC1=CC(=CC2=C1NC(=O)C(=O)N2)[N+](=O)[O-])C(C)C.Br

InChI

InChI=1S/C15H20N4O4.BrH/c1-8(2)18(9(3)4)7-10-5-11(19(22)23)6-12-13(10)17-15(21)14(20)16-12;/h5-6,8-9H,7H2,1-4H3,(H,16,20)(H,17,21);1H